SCHEMBL8429385

SCHEMBL8429385

CC(=O)c1cc(C)cc(C)c1OC(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.37
▸ KMT2A Q03164 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ ALDH1A1 P00352 3/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ HTT P42858 2/20 0.32
▸ PKM P14618 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ GFER P55789 1/20 0.31
▸ ADAM17 P78536 1/20 0.31
▸ TSHR P16473 3/20 0.31
▸ LMNA P02545 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ MMP1 P03956 1/20 0.31
▸ MMP2 P08253 1/20 0.31
▸ MMP9 P14780 1/20 0.31
▸ MMP8 P22894 1/20 0.31
▸ MMP13 P45452 1/20 0.31
▸ ABCB1 P08183 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8431119 0.78 KDM4E (0.41) KDM4EKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL15108831 0.76 KDM4E (0.47) KDM4EKMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL20033212 0.72 KMT2A (0.49) KMT2AMEN1ALDH1A1SMN1; SMN2HTT
SCHEMBL23812865 0.71 ALDH1A1 (0.40) KDM4EKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL2278969 0.70 ALDH1A1 (0.52) KDM4EKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL5435743 0.69 HTT (0.40) KMT2AMEN1ALDH1A1SMN1; SMN2HTT
SCHEMBL28020083 0.69 CYP3A4 (0.45) KDM4EKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL13596324 0.69 KDM4E (0.47) KDM4EALDH1A1SMN1; SMN2LMNACA1
SCHEMBL10052627 0.69 KMT2A (0.33) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL8429387 0.68 MEN1 (0.35) KMT2AMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5945382-A AND A METHOD OF THEIR PREPARATION BY CHLORINATION OF AN INTERMEDIATE ARYLPYRAZOLE; PROTECTION AGAINST FUNGAL DISEASES IN TOMATO, RICE, AND WHEAT PLANTS RHONE-POULENC AGROCHIMIE (FR) 1999-08-31 — — US disclosed
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